11-Hydroxynoracronycine

PubChem CID: 5378702

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Compound Synonyms	11-Hydroxynoracronycine, 27067-70-5, 11-Hydroxy-O-demethylacronine, Alkaloid A from Atalantia ceylanica, 5-Hydroxyacronine, 54E45U4Q3N, Alkaloid A, from Atalantia ceylanica, NSC 162687, NSC-162687, 5-HYDROXYNORACRONYCIN, UNII-54E45U4Q3N, CHEMBL447169, CHEBI:69044, DTXSID50181535, 7H-Pyrano[2,3-c]acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-, 3,12-Dihydro-6,11-dihydroxy-3,312-trimethyl-7H-pyrano(2,3-c)acridin-7-one, 3,12-DIHYDRO-6,11-DIHYDROXY-3,3,12-TRIMETHYL-7H-PYRANO(2,3-C)ACRIDIN-7-ONE, 7H-Pyrano(2,3-c)acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-, DTXCID90104026, BDBM50336483, NSC162687, Q27137385, 6,11-dihydroxy-3,3,12-trimethyl-pyrano[2,3-c]acridin-7-one, 7H-Pyrano[2, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-, 6,11-Dihydroxy-3,3,12-trimethyl-3,12-dihydro-7H-pyrano[2,3-c]acridin-7-one #, 7H-Pyrano(2,3-c)acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-(8CI), 7H-Pyrano(2,3-c)acridin-7-one, 3,12-dihydro-6,11-dihydroxy-3,3,12-trimethyl-(8CI)(9CI)
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	70.0
Hydrogen Bond Donor Count	2.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	CC1C2CCCCC2CC2C3CCCCC3CCC12
Np Classifier Class	Acridone alkaloids
Deep Smiles	OcccOCC)C)C=Cc6cc%10c=O)ccn6C))cO)ccc6
Heavy Atom Count	24.0
Classyfire Class	Quinolines and derivatives
Scaffold Graph Node Level	OC1C2CCCCC2NC2C3CCCOC3CCC12
Classyfire Subclass	Benzoquinolines
Isotope Atom Count	0.0
Molecular Complexity	560.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Uniprot Id	O60911
Iupac Name	6,11-dihydroxy-3,3,12-trimethylpyrano[2,3-c]acridin-7-one
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Organoheterocyclic compounds
Target Id	NPT601
Xlogp	3.5
Gsk 4 400 Rule	True
Molecular Formula	C19H17NO4
Scaffold Graph Node Bond Level	O=c1c2ccccc2[nH]c2c3c(ccc12)OCC=C3
Prediction Swissadme	0.0
Inchi Key	JZQDCDLYNFZBIG-UHFFFAOYSA-N
Silicos It Class	Moderately soluble
Fcsp3	0.2105263157894736
Logs	-3.967
Rotatable Bond Count	0.0
Logd	3.214
Synonyms	11-hydroxy-noracronycine
Esol Class	Moderately soluble
Functional Groups	c=O, cC=CC, cO, cOC, cn(c)C
Compound Name	11-Hydroxynoracronycine
Prediction Hob Swissadme	0.0
Exact Mass	323.116
Formal Charge	0.0
Monoisotopic Mass	323.116
Hydrogen Bond Acceptor Count	5.0
Molecular Weight	323.3
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	-5.376024266666667
Inchi	InChI=1S/C19H17NO4/c1-19(2)8-7-10-14(24-19)9-13(22)15-17(10)20(3)16-11(18(15)23)5-4-6-12(16)21/h4-9,21-22H,1-3H3
Smiles	CC1(C=CC2=C(O1)C=C(C3=C2N(C4=C(C3=O)C=CC=C4O)C)O)C
Nring	4.0
Np Classifier Biosynthetic Pathway	Alkaloids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Anthranilic acid alkaloids

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99. Outgoing r'ship FOUND_IN to/from Wrightia Arborea (Plant) Rel Props:Reference:

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11-Hydroxynoracronycine

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Phytochemical Properties

Associated Connections 99

Plant Connections 99