UNPD104565
AlkaPlorer ID: AK064895
Synonym: None
IUPAC Name: [(1S,2R,3R,4S,5R,6S,8R,9S,10S,13R,16S,17R,18S)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] (Z)-3-phenylprop-2-enoate
Structure
SMILES: CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)/C=C\C7=CC=CC=C7)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14
InChI: InChI=1S/C33H45NO7/c1-6-34-18-30(2)15-14-23(39-4)32-21-16-20-22(38-3)17-31(36,33(37,29(32)34)28(40-5)27(30)32)25(21)26(20)41-24(35)13-12-19-10-8-7-9-11-19/h7-13,20-23,25-29,36-37H,6,14-18H2,1-5H3/b13-12-/t20-,21-,22+,23+,25-,26+,27-,28+,29+,30+,31-,32+,33-/m1/s1
InChIKey: SJZWBVMZCIGKBJ-PNVGCUJTSA-N
Reference
Further norditerpenoid alkaloids from Delphinium cardiopetalum
PubChem CID: 101713174
LOTUS: LTS0276401
SuperNatural Ⅲ: SN0347624-02
NPASS: NPC225178
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Abies holophylla | Abies | Pinaceae | Pinales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
| Jatropha gossypiifolia | Jatropha | Euphorbiaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 567.7230000000002
TPSA？: 97.69
MolLogP？: 2.908800000000001
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|