(9S,27R)-4,15,21-trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.1³,⁷.1⁹,¹³.1¹⁹,²³.0¹⁷,³⁵.0²⁷,³⁴]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodecaene-16,20-diol
AlkaPlorer ID: AK325235
Synonym: None
IUPAC Name: 4,15,21-trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.13,7.19,13.119,23.017,35.027,34]hexatriaconta-1(31),3,5,7(36),13,15,17(35),19(34),20,22,29,32-dodecaene-16,20-diol
Structure
SMILES: COC1=CC=C2C=C1OC1=CC=C(C=C1)CC1C3=C(OC4=C(O)C(OC)=CC5=C4C(C2)N(C)CC5)C(O)=C(OC)C=C3CCN1C
InChI: InChI=1S/C37H40N2O7/c1-38-14-12-23-19-30(43-4)34(40)36-32(23)26(38)16-21-6-9-25(10-7-21)45-29-18-22(8-11-28(29)42-3)17-27-33-24(13-15-39(27)2)20-31(44-5)35(41)37(33)46-36/h6-11,18-20,26-27,40-41H,12-17H2,1-5H3
InChIKey: YVXUDJFUKQSSHZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Artemisia scoparia | Artemisia | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 624.7340000000002
TPSA？: 93.09
MolLogP？: 6.565000000000008
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|