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name Structure Reference Source Properties Activities Metabolism

Racemosidine C

AlkaPlorer ID: AK066473

Synonym: None

IUPAC Name: (1R,16S)-9,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaen-10-ol

Structure

SMILES: COC1=CC=C2C=C1OC1=C(OC)C=C3CCN(C)[C@H](CC4=CC=C(C=C4)OC4=C5C(=CC(O)=C4OC)CCN(C)[C@H]5C2)C3=C1

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InChI: InChI=1S/C37H40N2O6/c1-38-14-12-24-20-32(42-4)34-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(19-30(40)36(37)43-5)13-15-39(2)29(35)17-23-8-11-31(41-3)33(18-23)45-34/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m1/s1

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InChIKey: DQFIZQYILFTDPW-WDYNHAJCSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Cyclea racemosa Cyclea Menispermaceae Ranunculales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 608.735

TPSA？: 72.86

MolLogP？: 6.859400000000008

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens A2780 IC50 10000.0 nM 10.1021/np1001863
Homo sapiens Bel-7402 IC50 7530.0 nM 10.1021/np1001863
Homo sapiens HCT-8 IC50 6040.0 nM 10.1021/np1001863

Metabolism Information