ID: 78772
SMILES:C(CC=C(C)C)C(=CCCC(C)(c1c(O)cc(OC)c(C2C=C(C)CCC2)c1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -13.973
InChIKey:OBEUYTWVIRWTHO-UHFFFAOYSA-N
ID: 78773
SMILES:C1(O)C2(C)CCC(C(=C)C)C2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.299
InChIKey:CFSZBZUUCRWHDR-UHFFFAOYSA-N
ID: 78774
SMILES:C1(C(C)C)=CCC(O)(C)C2Oc3c(c(O)cc(C)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.601
InChIKey:PAEOPGOEOOKWQA-UHFFFAOYSA-N
ID: 78775
SMILES:CC1(C)CC(c2c(O)cc(CCCCC)cc2O)CC(O)(C)C1CCC(O)(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.618
CB1 binding score: -15.088
InChIKey:HFZDIXBBXPMMDC-UHFFFAOYSA-N
ID: 78776
SMILES:C1C(C)=C(C)CC2C1C(C)(C)Oc1c2cc2ccccc2c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.422
CB1 binding score: -15.6
InChIKey:VWXSWAMUBRTRRP-UHFFFAOYSA-N
ID: 78777
SMILES:CC1(O)Oc2c(c(CCCCC)cc(O)c2)C2C=CCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.768
InChIKey:INASYLTYWLHWIH-UHFFFAOYSA-N
ID: 78778
SMILES:C12C(=C(C)C(=O)O1)C1c3c(O)cc(CCCCC)cc3OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.144
InChIKey:YXQKHYGDCBHZGP-UHFFFAOYSA-N
ID: 78779
SMILES:C(CCC)Cc1cc2c(c(O)c1C(=O)O)CC(O)C(CCC1C(C)(O)CC=C1C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -14.258
InChIKey:JLSHCSLAAJVCLA-UHFFFAOYSA-N
ID: 78780
SMILES:C1(C)C2C(C=C(C)CC2)c2c(cc(O)cc2C)OC1C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -13.753
InChIKey:CFXHSYKARXOCQQ-UHFFFAOYSA-N
ID: 78781
SMILES:c12cc(CCCCC)cc(O)c1OC1(CCC(CCC=C(C)C)=CC1)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.525
InChIKey:QVNLYUOYHYUKDN-UHFFFAOYSA-N
ID: 78782
SMILES:O=C1C(C)CCC2C(C)(C)Oc3cc(C)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.387
InChIKey:IGANFYFOHLCKIW-UHFFFAOYSA-N
ID: 78783
SMILES:c12c(c(OC)cc(CCCCC)c1)OC1(C)CC2C(C(C)C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.653
InChIKey:VUPJIGZHNZJYRL-UHFFFAOYSA-N
ID: 78784
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 78785
SMILES:Oc1c(CCCCC)cc2c(c1O)C1C=C(C)CCC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.047
InChIKey:IPJUCVFYVXPSMP-UHFFFAOYSA-N
ID: 78786
SMILES:C(=CCOC(c1ccccc1)=O)C1(C)C2CC(O)C(C)=CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -13.657
InChIKey:ULMLVFUUSABZCP-UHFFFAOYSA-N
ID: 78787
SMILES:C(OC)(=O)C(C)=CCc1c2c(ccc1O)OC(C)(C)C1CCC(O)(C)C1(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -15.686
InChIKey:HLVJWRUTBRECIT-UHFFFAOYSA-N
ID: 78788
SMILES:C(C)CC(CCCC(C(Cc1cc(O)c2c(c1)OC(C)(C)C=C2)C)O)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.039
InChIKey:IPIASZCINVHEEG-UHFFFAOYSA-N
ID: 78789
SMILES:CC1(O)CC=C(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.239
InChIKey:OOOJYBUDBXZTPO-UHFFFAOYSA-N
ID: 78790
SMILES:C1(C)=CC2c3c(cc(CC[N+](C)(O)C)cc3O)OC(C(C)(OC)CCC=C(C)C)C2OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.591
CB1 binding score: -13.331
InChIKey:LKCCYSUYXJXIRJ-UHFFFAOYSA-O
ID: 78791
SMILES:C(CCC=CCc1cc2c(c(O)c1)C1C(O)C(C)(O)CCC1C(C)(C)O2)(C)(O)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -12.843
InChIKey:MMLKCONFARNJLE-UHFFFAOYSA-N
ID: 78792
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N