ID: 93241
SMILES:C(C1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1)C(=O)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -13.583
InChIKey:SIEYTWQTEYRSKD-UHFFFAOYSA-N
ID: 93242
SMILES:C(C(C12Oc3c(c(O)cc(CCCCC)c3)CC1c1c(c(OC)cc(C)c1O)O2)C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -14.83
InChIKey:IRWTXWVWPRVPTP-UHFFFAOYSA-N
ID: 93243
SMILES:O1C2C(C(C)C)C(C1)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.929
InChIKey:ZNPYTAUEADPXJJ-UHFFFAOYSA-N
ID: 93244
SMILES:C=C(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 93245
SMILES:C1(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 93246
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 93247
SMILES:C(CC=C(C)CO)=C1COC(=O)C2C1CCC1(C)C2Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -15.929
InChIKey:YYQRXZQATIRMSH-UHFFFAOYSA-N
ID: 93248
SMILES:O1C(C)(C)C2CCC3(C)C(C2(C)CC1)C(C)(c1cc(C)c(C)cc1O)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.884
InChIKey:GONGBUMGCZVRAT-UHFFFAOYSA-N
ID: 93249
SMILES:c1(O)cc(CC[CH]CC)c(C=O)c2c1C1CC(C)C=CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 341.471
CB1 binding score: -16.909
InChIKey:DLZHCJSDYJZHLW-UHFFFAOYSA-N
ID: 93250
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C(O)=O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.813
InChIKey:QLDYAVGSELETAD-UHFFFAOYSA-N
ID: 93251
SMILES:C(=O)(CC(O)C)OC1CC(C)C(CCC2(C)C=Cc3c(cc(C)c(O)c3C)O2)OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -14.683
InChIKey:UXJHSTBKFVJGLT-UHFFFAOYSA-N
ID: 93252
SMILES:OC(C)(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.956
InChIKey:PMKQBHFCFKZFGU-UHFFFAOYSA-N
ID: 93253
SMILES:o1c(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.496
InChIKey:YFDZZYBMGPHHKQ-UHFFFAOYSA-N
ID: 93254
SMILES:C1(C)(C)C(CCC(C)O)C(C)=CC(c2cc(CCc3cc(O)ccc3)cc(O)c2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.332
InChIKey:UYGBYNUPYOOGON-UHFFFAOYSA-N
ID: 93255
SMILES:CCC(=CCc1c2c(c(O)c(CC3=C(C)CC(C)(C)CC3)c1O)OC(C)(C)C1CCC(CO)=CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -14.217
InChIKey:LRWZEQYKSYLVRT-UHFFFAOYSA-N
ID: 93256
SMILES:Oc1c2c(cc(O)c1C(C(CC)C)=O)OC(C)(C)C1CC=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.246
InChIKey:IQVHZCCJYWKRTK-UHFFFAOYSA-N
ID: 93257
SMILES:Oc1c(-c2cc3c(cn2)COC3(C)C)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 407.51
CB1 binding score: -14.572
InChIKey:FPIOEVGVFGKBEP-UHFFFAOYSA-N
ID: 93258
SMILES:c1(CCCCC)c(C)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.856
InChIKey:VNACZUSHQSXMKX-UHFFFAOYSA-N
ID: 93259
SMILES:Oc1c(CCCC)ccc(O)c1C1C(C(CO)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.732
InChIKey:SNTCXARLWGSCFR-UHFFFAOYSA-N
ID: 93260
SMILES:C(Cc1[nH]ccc1)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1C#N
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.501
CB1 binding score: -13.165
InChIKey:XVKQDARMZYQLRZ-UHFFFAOYSA-N
ID: 93261
SMILES:CC(C)=CCc1c2c(c(O)c(C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.721
InChIKey:GHIQXOMIQDKQMR-UHFFFAOYSA-N