ID: 50212
SMILES:CC(C)CCCC(C)(O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.553
InChIKey:PQGPAQFWXILXKL-UHFFFAOYSA-N
ID: 50213
SMILES:CC1(C)Oc2c(c(O)c(C(=O)CC(C)C)c(O)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 50214
SMILES:C(c1cc2c(c(OC)c1OC(C=CCCC)=O)C=CC(CCC=C(C)C)(C)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -14.335
InChIKey:GDUKZGPFVGQOCB-UHFFFAOYSA-N
ID: 50215
SMILES:C(C)(CCC=C(C)C#CC=C(C)C)=CCc1c(O)c(C)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -17.639
InChIKey:NFVPJEXAKNHWTP-UHFFFAOYSA-N
ID: 50216
SMILES:c12cc(CCCCCC)c(C(=O)O)c3c1OC(C)(C)C1CCC(C)(O2)C31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.846
InChIKey:PSDROEZAIDZPBE-UHFFFAOYSA-N
ID: 50217
SMILES:C(CCC)Cc1cc2c(c(OC)c1)C1C(C2)C(O)(C)CCC1C(C)(OC(=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -13.441
InChIKey:ZOAVSWDZRHJPAV-UHFFFAOYSA-N
ID: 50218
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(COC(=O)C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 50219
SMILES:c1c(CCCCC)cc(C2C=C(C)CCC2C(=C)C)cn1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 283.459
CB1 binding score: -16.609
InChIKey:UUFQEPPTTDNAKK-UHFFFAOYSA-N
ID: 50220
SMILES:c12cc(CCCCC)cc(O)c1C(CCC=C(CCC=C(C)C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.405
InChIKey:SDDGBTOWJDYIIM-UHFFFAOYSA-N
ID: 50221
SMILES:c1(O)c(C)c(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.335
InChIKey:OANRDWLZYAFXPK-UHFFFAOYSA-N
ID: 50222
SMILES:C12C(C)CCC1C=C(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.808
InChIKey:SFUABGVTSMBNED-UHFFFAOYSA-N
ID: 50223
SMILES:C(CC)CCc1c(C(O)=O)c(O)c(CC=C(C)C)c(OC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -18.336
InChIKey:UJSSSFNGQWZNEN-UHFFFAOYSA-N
ID: 50224
SMILES:C(CO)=Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.751
InChIKey:SVQBWLSSLVMNBD-UHFFFAOYSA-N
ID: 50225
SMILES:CCCCCc1cc2c(oc1=O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.496
InChIKey:AMPYQCAZVSLXCV-UHFFFAOYSA-N
ID: 50226
SMILES:Oc1c(CC=C(CCC=C(C)C)C)cc(O)c(C(C(CCCCC)O)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -13.945
InChIKey:WAACDLQEBABSDK-UHFFFAOYSA-N
ID: 50227
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C)=C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N
ID: 50228
SMILES:CC1=CC(c2c(OC)c(OC)cc(CCc3ccccc3)c2)C(C(CCC=C(C)C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.675
CB1 binding score: -13.05
InChIKey:LRFSBBQFLZRBCP-UHFFFAOYSA-N
ID: 50229
SMILES:C(=C)(C)C1CCC(C)=C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.769
InChIKey:FMSBJXQNMWWJOB-UHFFFAOYSA-N
ID: 50230
SMILES:C(CC1(C)C2CC3C(C2C1)Oc1c3cc(O)cc1CCCCC)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.184
InChIKey:GBKTUPQBLZDFBE-UHFFFAOYSA-N
ID: 50231
SMILES:C(CCC(C)=CCCC(C)C=C1C(O)=NC(C(=O)O)C1)c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 501.62
CB1 binding score: -14.605
InChIKey:BVQALLHZIKGNFZ-UHFFFAOYSA-N
ID: 50232
SMILES:Oc1c(C(O)=O)c(CCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.521
InChIKey:IQSYWEWTWDEVNO-UHFFFAOYSA-N