Racemosidine B
AlkaPlorer ID: AK038520
Synonym: None
IUPAC Name: (1R,16S)-9,10,25-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-21-ol
Structure
SMILES: COC1=C2C=C3C(=C1)CCN(C)[C@@H]3CC1=CC=C(C=C1)OC1=C3C(=CC(OC)=C1OC)CCN(C)[C@H]3CC1=CC=C(O)C(=C1)O2
InChI: InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(42-4)36(37)43-5)13-15-39(2)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m1/s1
InChIKey: DGAIZFTYTKDOEN-WDYNHAJCSA-N
Reference
Chondrofoline from Uvaria ovata
PubChem CID: 46872238
CAS: 1236805-07-4
LOTUS: LTS0002601
SuperNatural Ⅲ: SN0064767-03
NPASS: NPC223690
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cyclea racemosa | Cyclea | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 608.7350000000004
TPSA？: 72.86000000000001
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 | 4620.0 | nM | 10.1021/np1001863 |
| Homo sapiens | HCT-8 | IC50 | 9720.0 | nM | 10.1021/np1001863 |