3,15-Diangeloylgermine
AlkaPlorer ID: AK112234
Synonym: 'Stenophylline A'
IUPAC Name: [(1S,2S,6S,9S,10S,11R,12R,13S,14S,15S,16R,18S,19S,22S,23S,25R)-10,12,14,16,23-pentahydroxy-6,10,19-trimethyl-13-[(Z)-2-methylbut-2-enoyl]oxy-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] (Z)-2-methylbut-2-enoate
Structure
SMILES: C/C=C(/C)C(=O)O[C@H]1CC[C@@]2(C)[C@@H]3C[C@@H](O)[C@H]4[C@@]5(O)[C@@H](C[C@@]42O[C@]13O)[C@@H]1CN2C[C@@H](C)CC[C@H]2[C@@](C)(O)[C@H]1[C@@H](O)[C@@H]5OC(=O)/C(C)=C\C
InChI: InChI=1S/C37H55NO10/c1-8-19(4)31(41)46-26-12-13-33(6)24-14-23(39)29-35(33,48-37(24,26)45)15-22-21-17-38-16-18(3)10-11-25(38)34(7,43)27(21)28(40)30(36(22,29)44)47-32(42)20(5)9-2/h8-9,18,21-30,39-40,43-45H,10-17H2,1-7H3/b19-8-,20-9-/t18-,21-,22-,23+,24-,25-,26-,27+,28+,29+,30-,33-,34+,35+,36-,37-/m0/s1
InChIKey: FZPUJFRMDZNVDJ-GKPRPLQPSA-N
Reference
Steroidal alkaloids from Veratrum dahuricum
PubChem CID: 102403791
LOTUS: LTS0127512
SuperNatural Ⅲ: SN0099810-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Veratrum dahuricum | Veratrum | Melanthiaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 673.8440000000004
TPSA？: 166.22
MolLogP？: 2.2201000000000004
Number of H-Donors: 5
Number of H-Acceptors: 11
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|