Rubeomycin A1
AlkaPlorer ID: AK084288
Synonym: None
IUPAC Name: (9S)-9-acetyl-7-[(4S,5S,6S)-4-amino-5-[(3S)-3-hydroxy-1-(1-hydroxypropan-2-yloxy)butoxy]-6-methyloxan-2-yl]oxy-4,6,9,11-tetrahydroxy-8,10-dihydro-7H-tetracene-5,12-dione
Structure
SMILES: CC(=O)[C@]1(O)CC2=C(O)C3=C(C(=O)C4=C(O)C=CC=C4C3=O)C(O)=C2C(OC2C[C@H](N)[C@H](OC(C[C@H](C)O)OC(C)CO)[C@H](C)O2)C1
InChI: InChI=1S/C33H41NO13/c1-13(36)8-22(44-14(2)12-35)47-32-15(3)45-23(9-19(32)34)46-21-11-33(43,16(4)37)10-18-25(21)31(42)27-26(29(18)40)28(39)17-6-5-7-20(38)24(17)30(27)41/h5-7,13-15,19,21-23,32,35-36,38,40,42-43H,8-12,34H2,1-4H3/t13-,14?,15-,19-,21?,22?,23?,32+,33-/m0/s1
InChIKey: DNHXZQIEIKSDIK-IDXJFLDESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nonomuraea roseoviolacea | Nonomuraea | Streptosporangiaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 659.6850000000003
TPSA？: 235.53
MolLogP？: 1.2445999999999997
Number of H-Donors: 7
Number of H-Acceptors: 14
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|