ID: 117748
SMILES:C1CC(C(OC)=O)=CC2C1C(C)(C)Oc1c2c(O)c(C(=C)CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -14.571
InChIKey:QSINWUGLTFGENY-UHFFFAOYSA-N
ID: 117749
SMILES:C1CC(C(C=O)=C)C(c2c(O)c(O)cc(CCCCC)c2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -12.522
InChIKey:QSISDJRQUGJWHO-UHFFFAOYSA-N
ID: 117750
SMILES:C12C(C)CCC3C(C)(C)Oc4cc(CCCCC)cc(c14)OC23C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.99
InChIKey:WVYUQAHYRVOWLK-UHFFFAOYSA-N
ID: 117751
SMILES:C(=C(C)C)CCC(=CCc1c(O)cc2c(c1)C=CC(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.589
InChIKey:VZPNCTIRZGXQIQ-UHFFFAOYSA-N
ID: 117752
SMILES:c12cc(CCCCC)cc(O)c1CC1C(C)(O2)OCC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -18.651
InChIKey:ACBZSAOYIMELFI-UHFFFAOYSA-N
ID: 117753
SMILES:O=C1C(C)C2Oc3c(cc(O)cc3CCCCC)C(C=C(C)C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -12.816
InChIKey:UPWCKFBCXHCIIL-UHFFFAOYSA-N
ID: 117754
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 117755
SMILES:C12C(C(C)C)C(CC(C)C1)c1c(O)cc(CCCCC)cc1OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.552
InChIKey:YDIPYWJJMQSNIZ-UHFFFAOYSA-N
ID: 117756
SMILES:C1CC(C(=C)C)C(c2cc(CCC(O)C(C)(O)C)c(C)cc2OC)(C)Oc2c(C)cc(OC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -13.501
InChIKey:WBRDXJWIRHCORS-UHFFFAOYSA-N
ID: 117757
SMILES:C(CCc1cc(O)cc(C)c1)C(C)=CCC1(C)C(C)=CC(=O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -12.6
InChIKey:VVDHTQQPELBBAY-UHFFFAOYSA-N
ID: 117758
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(C)=C)C(=O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.041
InChIKey:OGBMOZZBYDWKQG-UHFFFAOYSA-N
ID: 117759
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 117760
SMILES:C1=CC(C)(C)Oc2cc(CCCC)c(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.388
InChIKey:BIBSIAKYSAAALC-UHFFFAOYSA-N
ID: 117761
SMILES:Oc1cc(CCCCC)cc2c1C1C(=C(C)C2)CCC(C(=C)C)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.562
CB1 binding score: -13.023
InChIKey:CQKQLBBIVMBKGM-UHFFFAOYSA-N
ID: 117762
SMILES:C1(C)(C)C2=C(c3c(cc(CCCCC)cc3O)O1)C(CC=C(C)C)C(=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.929
InChIKey:XIUHTSBHTJIDBD-UHFFFAOYSA-N
ID: 117763
SMILES:c1c(OC(=O)C)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.827
InChIKey:KZDBMWSJBMYKAQ-UHFFFAOYSA-N
ID: 117764
SMILES:c1(O)cc(CCCCC)cc(O)c1C1OC(=O)C(CCO)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -17.481
InChIKey:APHOHYLUVBBFEJ-UHFFFAOYSA-N
ID: 117765
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)(C=CC(O)(C)C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -12.279
InChIKey:AGTLJFXTXFBUMA-UHFFFAOYSA-N
ID: 117766
SMILES:C(C)(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:VYJAUHGKLKGZJR-UHFFFAOYSA-N
ID: 117767
SMILES:c1(O)cc2c(o1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.295
CB1 binding score: -17.361
InChIKey:ULTIEVZHKXNXAI-UHFFFAOYSA-N
ID: 117768
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N