ID: 122284
SMILES:C1=C2C3C(OC(=O)CCCCCCC)OC(C)(C)C3CCC2(C)Oc2cc(C)c(O)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.669
InChIKey:LNWWOXQBEDKUIC-UHFFFAOYSA-N
ID: 122285
SMILES:C1(C)CCC2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 122286
SMILES:C(=C)(C)C1C(c2c(O)cc(CCC)cc2O)C2C(C)CC(C=C(C)C)OC2=C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.299
InChIKey:WQSSKSMNWZBZLA-UHFFFAOYSA-N
ID: 122287
SMILES:c1(OC(C)=O)cc(C2C=C(C)C(O)CC2C(C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.39
InChIKey:BVXJRJFZCRSMNM-UHFFFAOYSA-N
ID: 122288
SMILES:c12cc(CCCCC)cc(O)c1C1=CC3(C)C(CC1(C)C(=O)O3)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -14.79
InChIKey:TXDCTVGEQPSGAA-UHFFFAOYSA-N
ID: 122289
SMILES:O(c1c2c(cc(CCCCC)c1)OC1(C)C(C2(C)C)CCC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.072
InChIKey:IINJCFCSAVUXJM-UHFFFAOYSA-N
ID: 122290
SMILES:C1(OCC)C2C3Oc4c(cc(O)cc4)C=C3CCC2(C)Oc2c(C)c(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -17.694
InChIKey:FPJAQYASKIFSLZ-UHFFFAOYSA-N
ID: 122291
SMILES:c12c(cc(CCCCC)cc1OC)OC(C)(C)C1C2C(=O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.81
InChIKey:BMNHMXYHRYMSLW-UHFFFAOYSA-N
ID: 122292
SMILES:c1(C(N)N)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.391
CB1 binding score: -16.692
InChIKey:UIOXKJHEYCLSEO-UHFFFAOYSA-N
ID: 122293
SMILES:c1(C2C(C(=C)C)CCC(C)=C2)c(O)cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.32
InChIKey:PAUXQOYPCTXHFI-UHFFFAOYSA-N
ID: 122294
SMILES:CCCCCc1cc(O)c(C2C(C(C)=C)C(c3ccc(O)cc3)CC(C)(O)C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.743
InChIKey:LYBLBINKAAVPMV-UHFFFAOYSA-N
ID: 122295
SMILES:CC1C2Cc3c(O)cc(CCCCCCCCC)c(C)c3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -16.771
InChIKey:ZATVPKPBSHNJDM-UHFFFAOYSA-N
ID: 122296
SMILES:C1C(C)=CC(c2c(O)cc(C)c(OC)c2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.899
InChIKey:JYURTPNPFFXLFB-UHFFFAOYSA-N
ID: 122297
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.108
InChIKey:PPZWAHLWZVOCDJ-UHFFFAOYSA-N
ID: 122298
SMILES:C(C(C)=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C)C=C(C1OC(CC)(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.722
CB1 binding score: -14.173
InChIKey:CFIFILBNGDKKRV-UHFFFAOYSA-N
ID: 122299
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 122300
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 122301
SMILES:C(CCCC)Cc1cc(O)cc2c1OC(C)(C)C1C=CC(C)(O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.723
InChIKey:PITKKMNUHQJDTO-UHFFFAOYSA-N
ID: 122302
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 122303
SMILES:CC(C)C1CC(=O)C2=CCCC(C(c3cc4c(cc3)OC(C)(C)C4O)=C2)=C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -16.794
InChIKey:ZISRRNGRCQJSHU-UHFFFAOYSA-N
ID: 122304
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2O)C1C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.334
InChIKey:XBCSXUYXVCTQRG-UHFFFAOYSA-N