ID: 36394
SMILES:c1(O)c2c(c(CCCCC)cc1O)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -18.17
InChIKey:BKSJVUHQOUSHLD-UHFFFAOYSA-N
ID: 36395
SMILES:C(C(=CCc1c(O)cc(O)cc1CCCCC)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 36396
SMILES:O(c1c2c(cc(O)c1Br)CC1C(C)(O)CCC1C(C)(C)O2)C(CCCCC)C(OC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 499.442
CB1 binding score: -13.174
InChIKey:NMRRYPHCWDWSJW-UHFFFAOYSA-N
ID: 36397
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 36398
SMILES:OC12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.89
InChIKey:IDRHKXASCVUDQM-UHFFFAOYSA-N
ID: 36399
SMILES:C(CCCc1cc2c(c(O)c1)C1CC3C2(CO1)CCC3C(OC)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.685
InChIKey:HUTVUKVOWPSMJA-UHFFFAOYSA-N
ID: 36400
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C(OC(=O)C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.221
InChIKey:FBWROUKBFDGVGS-UHFFFAOYSA-N
ID: 36401
SMILES:C(C)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 36402
SMILES:C(CCC)Cc1cc2c(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: 36403
SMILES:OC1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2C(C)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -13.598
InChIKey:LXLIAJSHGOKSNU-UHFFFAOYSA-N
ID: 36404
SMILES:C12c3c(cc(CCCC)cc3O1)OC(C)(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -15.341
InChIKey:YVZSQPMKDSWLES-UHFFFAOYSA-N
ID: 36405
SMILES:C1C2C(C)(C)Oc3c(c(OC(C)=O)c(CC=C(CCC=C(C)C)C)c(O)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.929
InChIKey:LHAHSHMZMVCTJD-UHFFFAOYSA-N
ID: 36406
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C(OC)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 36407
SMILES:c12c(cc(CCC)cc1O)OC(CO)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 252.31
CB1 binding score: -16.793
InChIKey:RCIXPGARSJLGAU-UHFFFAOYSA-N
ID: 36408
SMILES:C(C)CCCc1ccc2c(c1O)C(O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.813
InChIKey:SOYXZRZYKQZFEE-UHFFFAOYSA-N
ID: 36409
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.729
InChIKey:SFECBMBCGGYPPV-UHFFFAOYSA-N
ID: 36410
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 36411
SMILES:C(c1cc(OC(C)=O)c2c(c1)OC(C)(C)C1CCC(=C)C1(C)O2)CCCCC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -13.217
InChIKey:NOSITPVCPVIPOC-UHFFFAOYSA-N
ID: 36412
SMILES:c1(O)c2c(c(C=O)c(O)c1C(C)C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.495
InChIKey:GQLDHMIGVSYIAG-UHFFFAOYSA-N
ID: 36413
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.329
InChIKey:OGTYERSWJNGKFK-UHFFFAOYSA-N
ID: 36414
SMILES:C1(CCC(CC)C)(C)Oc2c(c(O)c(C(OC)=O)c(O)c2)C2C=C(C(C)(C)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.995
InChIKey:XUGHVEGRCZAOJI-UHFFFAOYSA-N