Guadiscidine

AlkaPlorer ID: AK265307

Synonym: 6,8-Dihydro-8,8-dimethyl-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol 

IUPAC Name: 13,13-dimethyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,11,14(19),15,17-heptaen-16-ol

Structure

SMILES: CC1(C)C2=NCCC3=C2C(=C2OCOC2=C3)C2=CC=C(O)C=C21

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InChI: InChI=1S/C19H17NO3/c1-19(2)13-8-11(21)3-4-12(13)16-15-10(5-6-20-18(15)19)7-14-17(16)23-9-22-14/h3-4,7-8,21H,5-6,9H2,1-2H3

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InChIKey: ACEGJFAVMPCJIT-UHFFFAOYSA-N

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Reference

PubChem CID: 163025975

SuperNatural Ⅲ: SN0001659

NPASS: NPC14296

COCONUT: CNP0303584

Properties Information

Molecule Weight: 307.34900000000005

TPSA: 51.05

MolLogP: 3.4243000000000023

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information