ID: 91099
SMILES:C1(CC=CC(OC)(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.446
InChIKey:GOXSRTBGOHOVMN-UHFFFAOYSA-N
ID: 91100
SMILES:c1(CCCC)c(O)cc2c(c1O)C1C(C(C)(C)O2)CC2C(C)(C)CCCC2(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.729
InChIKey:MFOFCIARZLUQOT-UHFFFAOYSA-N
ID: 91101
SMILES:CC1(C)C2C(C)(CCC1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 91102
SMILES:C1=C(C)CCC=C(C)CC(c2c(O)cc(CCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.623
InChIKey:CIDYYRSZJPKYSB-UHFFFAOYSA-N
ID: 91103
SMILES:C1C(C(C)C)C2c3c(cc(CCCCC)cc3O)OC(C)(CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.036
InChIKey:GXFRYRHSTXPKCQ-UHFFFAOYSA-N
ID: 91104
SMILES:c12cc(CCCCC)cc(O)c1C1C3C(C)(OC(C)(CCC=C(C)C)O1)OC2OC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.889
InChIKey:LZZRMNZLQMGNCP-UHFFFAOYSA-N
ID: 91105
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 91106
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 91107
SMILES:c1(O)c(C2C(C(C)C)CCC(C)=C2)c(O)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.347
InChIKey:YVODSFDYVJCQJH-UHFFFAOYSA-N
ID: 91108
SMILES:CC12C(C)(C(=CC)C(=O)C1O)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.22
InChIKey:JWANRCPHVFXIAX-UHFFFAOYSA-N
ID: 91109
SMILES:C1(C)C(C)(CCC(CCc2c(O)c(C)cc(O)c2)C)C(C)CCC1=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -12.373
InChIKey:VFTQVVQDIGCFPK-UHFFFAOYSA-N
ID: 91110
SMILES:C(C)(C)=CCCC1(C)C(O)Cc2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.686
InChIKey:LLPMAUMTANBRBH-UHFFFAOYSA-N
ID: 91111
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(OC)ccc(CC[N+](C)(O)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.492
CB1 binding score: -17.083
InChIKey:APHOZERXLQQVOV-UHFFFAOYSA-N
ID: 91112
SMILES:C1(C)=CCC(C(O)(C)C)CC1c1cc(CCC=C(C)C)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.475
InChIKey:DQSYEWFNBOKWFU-UHFFFAOYSA-N
ID: 91113
SMILES:C1CC(CO)=CCC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -13.621
InChIKey:WREDKMAWGYVSOY-UHFFFAOYSA-N
ID: 91114
SMILES:COCC1OC(c2c(O)cc(CCCCC)cc2O)C=C(CCC=C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -14.825
InChIKey:CCVUCYSVKZHKHV-UHFFFAOYSA-N
ID: 91115
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(CCC=C(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: 91116
SMILES:CC1(C)Oc2cc(CCCCC)c(O)cc2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 91117
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 91118
SMILES:CC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 91119
SMILES:O(C(C(=CC)C)=O)C1CC2C(C)(Oc3c2c(OC)cc(CCCCC)c3)C2C1(C)CCC2C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -15.574
InChIKey:BMECWBKAJMMPJZ-UHFFFAOYSA-N