ID: 41959
SMILES:C1C(=C(C)C)CCC(C)=C1CCC1(C)C=Cc2cc(OC(C)=O)cc(C)c2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -13.966
InChIKey:JROQJTQXWQEJLD-UHFFFAOYSA-N
ID: 41960
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C(=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.771
InChIKey:VGSHJKOXKGYENI-UHFFFAOYSA-N
ID: 41961
SMILES:C(CCC)Cc1cc(O)c2c3c1OC(C(O)(C)C)C3CC(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -12.36
InChIKey:GIYRAFJTKVFFJQ-UHFFFAOYSA-N
ID: 41962
SMILES:C(=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C)(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 41963
SMILES:C(=C(C)C)CCC1(C)Oc2cc(CCCCCO)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.433
InChIKey:WRKRLMFHDYYVAX-UHFFFAOYSA-N
ID: 41964
SMILES:c1(CC(O)=O)c(C2C(C)CCC2C(=C)C)cc(O)cc1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.762
InChIKey:VLRMTWMNYAXPKI-UHFFFAOYSA-N
ID: 41965
SMILES:C(C1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 41966
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.831
InChIKey:PRBYMEIBAFVCKU-UHFFFAOYSA-N
ID: 41967
SMILES:O1c2c(C(=O)C(CC)C)c(O)cc3c2C(CC1(C)C)C=CC(C)(C)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.424
InChIKey:CPYAXLBCJOZZTH-UHFFFAOYSA-N
ID: 41968
SMILES:C1(C)=C2C(C3C(C(C)(C)Oc4cc(CCCCC)cc(O)c43)CC1)C=C(C=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -16.533
InChIKey:NSEVKPBDVZGPJB-UHFFFAOYSA-N
ID: 41969
SMILES:CC(C)=CCc1c(OC2OC(CO)C(O)C(O)C2O)c(CC=C(CCC=C(C)C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.61
CB1 binding score: -16.923
InChIKey:WEAQUOSRYXYIBO-UHFFFAOYSA-N
ID: 41970
SMILES:C(CCCCCCC)CCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -17.824
InChIKey:SNQWHXRTUXZXPM-UHFFFAOYSA-N
ID: 41971
SMILES:c1c(CCCCC)cc(O)c2c1OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 41972
SMILES:CC1=CCCC(O)(C)C2C(CC1)C(C)(C)Oc1c2c(OC)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.792
InChIKey:LHHDLRJKYXKEBQ-UHFFFAOYSA-N
ID: 41973
SMILES:C1(CO)(C)Oc2cc(C)c(O)cc2C2C1CC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -13.698
InChIKey:VGLSLYUIKJZAEE-UHFFFAOYSA-N
ID: 41974
SMILES:C12=C(C)CCC1C(C)(C)Oc1c(C(OC)=O)c(CCCCC)c(O)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.845
InChIKey:OXTWFJGNLAFEAF-UHFFFAOYSA-N
ID: 41975
SMILES:C1=CC2(C)C(C3=C1CC1c4c(cc(C)cc4O)OC(C)(C)C1C3)OC(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -16.502
InChIKey:CAQWYNZGFFICTR-UHFFFAOYSA-N
ID: 41976
SMILES:CC(C1(C)CCC(C)=CC1c1ccc(CCCCC)cc1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.498
CB1 binding score: -16.033
InChIKey:XMVQEGZRZCHJAX-UHFFFAOYSA-N
ID: 41977
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 41978
SMILES:O1C(=O)C(C)C2C13Oc1c(c(OC)cc(CCCCC)c1)C3C1OC1C2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -16.033
InChIKey:DPLLYIGARQEYLE-UHFFFAOYSA-N
ID: 41979
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1=C2C(O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.216
InChIKey:RIPYFNDWLHZSJP-UHFFFAOYSA-N