kabiramide C
AlkaPlorer ID: AK000861
Synonym: '', 'KABIRAMIDE C', '100045-78-1', 'kabiramide C', 'Kabiramide C', '(10R,11S,12S,14R,16S,20S,21R,22S,24E)-16-(R)-amino(hydroxy)methoxy-12-hydroxy-20-{(2S,3S,7R,8R,9R,10E)-11-(hydroxymethyl)(methyl)amino-2,8-dimethoxy-3,7,9-trimethyl-6-oxoundec-10-en-1-yl}-10,22-dimethoxy-11,14,21-trimethyl-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo24.2.1.1~2,5~.1~6,9~hentriaconta-1(28),2(31),4,6(30),8,24,26(29)-heptaen-18-one'
IUPAC Name: [(10R,11S,12S,14R,16S,20S,21R,22S)-20-[(2S,3S,7R,8R,9R)-11-[formyl(methyl)amino]-2,8-dimethoxy-3,7,9-trimethyl-6-oxoundec-10-enyl]-12-hydroxy-10,22-dimethoxy-11,14,21-trimethyl-18-oxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.12,5.16,9]hentriaconta-1(28),2(31),4,6(30),8,24,26(29)-heptaen-16-yl] carbamate
Structure
SMILES: CO[C@H]([C@H](C)C=CN(C)C=O)[C@@H](C)C(=O)CC[C@H](C)[C@H](C[C@@H]1OC(=O)C[C@@H](OC(=N)O)C[C@H](C)C[C@H](O)[C@H](C)[C@@H](OC)C2=COC(=N2)C2=COC(=N2)C2=COC(=N2)C=CC[C@H](OC)[C@H]1C)OC
InChI: InChI=1S/C48H71N5O14/c1-27-19-33(66-48(49)58)21-43(57)67-41(22-40(60-9)28(2)15-16-37(55)30(4)44(61-10)29(3)17-18-53(7)26-54)32(6)39(59-8)13-12-14-42-50-35(24-63-42)46-52-36(25-65-46)47-51-34(23-64-47)45(62-11)31(5)38(56)20-27/h12,14,17-18,23-33,38-41,44-45,56H,13,15-16,19-22H2,1-11H3,(H2,49,58)/t27-,28-,29+,30-,31-,32+,33-,38-,39-,40-,41-,44+,45+/m0/s1
InChIKey: VDALFVIVHBKWES-KFROEDSTSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Colchicum szovitsii | Colchicum | Colchicaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Brassica napus | Brassica | Brassicaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 942.117
TPSA？: 252.2299999999999
MolLogP？: 7.612870000000009
Number of H-Donors: 3
Number of H-Acceptors: 17
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|