ID: 3970
SMILES:CC(=O)Oc1c2c(c(C(CCCC)C(C=CC(C)(C)O)=O)cc1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -15.358
InChIKey:UVWUPLMAUKGSJL-UHFFFAOYSA-N
ID: 3971
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 3972
SMILES:c1(OC)cc(CCCCC)cc2c1C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.239
InChIKey:UZKGLBDVRIILHT-UHFFFAOYSA-N
ID: 3973
SMILES:O=C(c1c(O)c2c(cc1CCCCC)OC(C)(CCC=C(C)C)C=C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.831
InChIKey:NSAYPKBWNNECRY-UHFFFAOYSA-N
ID: 3974
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 3975
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 3976
SMILES:c1c(CCCCO)cc2c(c1O)OC1(C)C3CC(C1(C)C)CC=C2C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.515
InChIKey:YWLMCHRPIGZXQF-UHFFFAOYSA-N
ID: 3977
SMILES:O1C2C(=C(c3c(O)cc(CCCCC)cc3O)C(C=C)(C)C2)CC1C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.1
InChIKey:ALABGGSHFDPZKJ-UHFFFAOYSA-N
ID: 3978
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 3979
SMILES:c1c(O)c2c(c(C3OC(C=C(C)C)C(O)C3(C)C)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -17.126
InChIKey:DHQSBYHMGXYWSZ-UHFFFAOYSA-N
ID: 3980
SMILES:C12C(C)CCC1C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.026
InChIKey:UWJTXRBBWOXUPZ-UHFFFAOYSA-N
ID: 3981
SMILES:O(C)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.752
InChIKey:ZYXQGFVKCRMWOJ-UHFFFAOYSA-N
ID: 3982
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1=CC2(C)C(=O)CC1)(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.879
InChIKey:AWRAQIKYWOVEGF-UHFFFAOYSA-N
ID: 3983
SMILES:C(C(C)=CCc1c(O)cc(C(CO)C(=O)O)c(O)c1)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.317
InChIKey:BXPPYZQGESXNLT-UHFFFAOYSA-N
ID: 3984
SMILES:O(C)c1c(C(=O)C(C)C)c2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.277
InChIKey:XKGYBDXCGGGQCW-UHFFFAOYSA-N
ID: 3985
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)-c2cc(C=O)c(C=O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.429
CB1 binding score: -15.017
InChIKey:NVZPCHCFJKLCHY-UHFFFAOYSA-N
ID: 3986
SMILES:C1(N=CO)(C)CCC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 359.51
CB1 binding score: -15.766
InChIKey:DDCYYHZBCYVFEI-UHFFFAOYSA-N
ID: 3987
SMILES:c1(OC)c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.792
InChIKey:VDKAKXBXSAFIMF-UHFFFAOYSA-N
ID: 3988
SMILES:c12c(c(CCCC)cc(C(O)=O)c1)OC(C)(C)C(Br)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 341.245
CB1 binding score: -15.75
InChIKey:YNZYDDAEWGUXCL-UHFFFAOYSA-N
ID: 3989
SMILES:C(C)c1c2c3c(cc1O)OC(C)(C)C1CCC(C)(O3)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.097
InChIKey:QXFRYRMYLHOQQH-UHFFFAOYSA-N
ID: 3990
SMILES:C12c3c(O)cc(CCCCCC)cc3OC(CCC1C(C)=C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.109
InChIKey:WFAIFUQEJQQHAX-UHFFFAOYSA-N