ID: 116572
SMILES:C(C(C)=CCCC(C(O)=O)=CCc1c(O)cc(CCC)cc1OC(C)=O)=C=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.444
CB1 binding score: -13.196
InChIKey:ODRFOKYLIMMACN-UHFFFAOYSA-N
ID: 116573
SMILES:C(C(=CCc1c(O)cc(CCCCC)cc1OC)C)=CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.502
InChIKey:SSFQFIDRXPCVFV-UHFFFAOYSA-N
ID: 116574
SMILES:c1c(C2C(C(=C)C)CCC(C)=C2)cc(CCC(=O)O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -12.822
InChIKey:VBHKRNNSEDCRJR-UHFFFAOYSA-N
ID: 116575
SMILES:C12CCC(C)C13Cc1c(O)cc(C)cc1OC(C)(C)C23
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.685
InChIKey:NVQZVVAOLYFVGH-UHFFFAOYSA-N
ID: 116576
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 116577
SMILES:Oc1c(CC2CC(C(C)C)C(CO)C=C2C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.652
InChIKey:UCTHWXAWPCXEIR-UHFFFAOYSA-N
ID: 116578
SMILES:c1(C)cc(Cc2cc(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.506
InChIKey:HXEZYHQNKJUBNZ-UHFFFAOYSA-N
ID: 116579
SMILES:C1C(C)CC(OC(C)=O)C2C(C1)C(C)(C)Oc1cc(CCCC(OC)=O)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -15.93
InChIKey:BOUZGFNCWZALOF-UHFFFAOYSA-N
ID: 116580
SMILES:C1(CCC=C(C)C)=CCCC2(C)Oc3c(c(O)cc(C)c3)C3C12C(=O)C(C)C(C)C3O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.367
InChIKey:PJFUMQHVMFNCGX-UHFFFAOYSA-N
ID: 116581
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(CCC=C(C)C)C)CC1OC(C1(C)CCC2C(C)(CC1)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.823
CB1 binding score: -13.142
InChIKey:REKSSLYLYJIQKH-UHFFFAOYSA-N
ID: 116582
SMILES:CC(C)C1C2Oc3c(c(O)cc(CCCCC)c3)C1C(O)C(O)(C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -15.065
InChIKey:ROXFRJUZGFNEER-UHFFFAOYSA-N
ID: 116583
SMILES:C1(C(C)=C)C(c2ccc(CCCCC)cc2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 116584
SMILES:CC1(C)CCCC(C)=C1CCC(C)(O)C=Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.591
InChIKey:KHMJHSBARAGJSG-UHFFFAOYSA-N
ID: 116585
SMILES:C12C(C)(O)CCC1C(CCC=C(C)C)(C)Oc1c2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.874
InChIKey:CKXJEBZTEGWJCV-UHFFFAOYSA-N
ID: 116586
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116587
SMILES:c1c(CCCCC)cc2c(c1OC)OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.253
InChIKey:GUKVLMTZLHYXOE-UHFFFAOYSA-N
ID: 116588
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116589
SMILES:CC1(CCCC(C)=C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.693
InChIKey:WSEYAJSVUKANLY-UHFFFAOYSA-N
ID: 116590
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(C)CC(O)C=C(C)C)c(OC)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.222
InChIKey:YJPFMXNQNDLYPA-UHFFFAOYSA-N
ID: 116591
SMILES:C12(C)CCC(C(O)(C)C)C1c1c(O)cc(CCCCCC)cc1OC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.679
InChIKey:AWLKCDDZPHZOLB-UHFFFAOYSA-N
ID: 116592
SMILES:c12ccc(O)cc1CC1C(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.593
InChIKey:NGCPBWWYWJPVNH-UHFFFAOYSA-N