ID: 99079
SMILES:C(C(C)c1cc(O)c(C2C(C(=O)C)CCC(C)=C2)c(O)c1)CCC(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.512
InChIKey:VLYBWPKIISTLPZ-UHFFFAOYSA-N
ID: 99080
SMILES:C(C)CCCc1cc(O)c2c(c1)OC1(CCC3C(C)(O1)CCC(C(O)(C)C)O3)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -12.944
InChIKey:PJFWPDXNJVCUIV-UHFFFAOYSA-N
ID: 99081
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)c2c(c1)C1C3=C(C)CCC1C(C)(C)Oc1c3c(cc(C(C)C)c1O)OC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.742
CB1 binding score: -12.352
InChIKey:IYMHDHQGAOZWJX-UHFFFAOYSA-N
ID: 99082
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C1(C)C)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.62
InChIKey:NPMCKBUDGYKIRG-UHFFFAOYSA-N
ID: 99083
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(=C)C)CC3C(C1)(OC3)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.569
InChIKey:MVQXOSWEVDURRC-UHFFFAOYSA-N
ID: 99084
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C(=O)O)CCC2C(C)(OC)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -13.897
InChIKey:JVDRUAAQZLMJDI-UHFFFAOYSA-N
ID: 99085
SMILES:c1(CCCC)c(C(OC)=O)cc2c(c1O)CC1(O2)C(C)(C)C(C)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.321
InChIKey:HGNSQMMFYAJEPV-UHFFFAOYSA-N
ID: 99086
SMILES:O1c2cc(CCC)cc(O)c2C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 99087
SMILES:c1(C2C(C(C)=C)CC(O)C(=C)C2)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.128
InChIKey:JAPBJYQQRLYTLO-UHFFFAOYSA-N
ID: 99088
SMILES:C(C)C(C(=O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.393
InChIKey:QOGIZIKVPXCHSX-UHFFFAOYSA-N
ID: 99089
SMILES:C12OC1(C)CC1OC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.018
InChIKey:RQOQCVCCFGOMSJ-UHFFFAOYSA-N
ID: 99090
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 99091
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccccc3)c2)C2CC(C)=CCC12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 99092
SMILES:c1(CCCCC)c2c(cc(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.165
InChIKey:VBYUZBSQYMNTJZ-UHFFFAOYSA-N
ID: 99093
SMILES:c1(C)oc(=O)c(Cc2c(O)c(CC=C(C)CCC=C(C)C)c(OC)c(CC=C(C)C)c2O)c(O)c1C1C=C(C)CCC1C(CO)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 632.838
CB1 binding score: -13.503
InChIKey:YWIINZCHOGNLRZ-UHFFFAOYSA-N
ID: 99094
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 99095
SMILES:C(C1(O)COC2C(C(=C)C)C3C(CC(=O)C(C)=C3OC2)C1(C)C)Oc1cc(O)c(C(=O)OCCCC)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.669
CB1 binding score: -16.124
InChIKey:GMNJCVBSDUYWDC-UHFFFAOYSA-N
ID: 99096
SMILES:CC(=O)OC(=O)c1c(OC)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.381
InChIKey:XEAHTVAXMLQQRG-UHFFFAOYSA-N
ID: 99097
SMILES:C(CCCCCO)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1C1C(O)C(O)C(O)C(CO)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.69
CB1 binding score: -16.529
InChIKey:NXYYFZHAGCXSLH-UHFFFAOYSA-N
ID: 99098
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 99099
SMILES:C1C2C(C)=CCC1C(CCC=C(C)C)(C)Oc1c2c(O)c(CC=C(CCC=C(C)C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -16.321
InChIKey:SHPQIJRNRUQSAA-UHFFFAOYSA-N