ID: 32866
SMILES:CC(=O)OC1C2(C)CCC(C(C)C)C2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.679
InChIKey:OSVSYPBMXLJBEI-UHFFFAOYSA-N
ID: 32867
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32868
SMILES:C1(O)C(C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 222.284
CB1 binding score: -16.7
InChIKey:XZWYKOFKGVNGQV-UHFFFAOYSA-N
ID: 32869
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=C(C)CCC3C(C21C)CCC3=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -15.708
InChIKey:KQUKFKMLLPKQAW-UHFFFAOYSA-N
ID: 32870
SMILES:CC1(C)Oc2cc(C)c(O)cc2C2C(C)(CSC#N)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.454
CB1 binding score: -17.523
InChIKey:ASMSRPDHWIMUDQ-UHFFFAOYSA-N
ID: 32871
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1)C(CCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -17.61
InChIKey:RRSOJODSSKABLV-UHFFFAOYSA-N
ID: 32872
SMILES:C12C(c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(C)C)CC(C)=CCCC(O)(C)C1OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.703
CB1 binding score: -11.625
InChIKey:QTAWIDRPHNYCQR-UHFFFAOYSA-N
ID: 32873
SMILES:c1(-c2ccc(OC)cc2)c(O)cc2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -16.327
InChIKey:HVHPTASVQAPOPK-UHFFFAOYSA-N
ID: 32874
SMILES:c1(O)cc(CCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 32875
SMILES:C1C2C(C(C)(C)Oc3c2c(O)cc(CCc2ccccc2)c3)CCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -16.029
InChIKey:UKVPMVAGGWUHHT-UHFFFAOYSA-N
ID: 32876
SMILES:C1(C)=CC2OC3(C)C4C(c5c(O)cc(CCCCC)cc5OC3(CC2(O)C)C1)C4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -11.791
InChIKey:VYAURLRBBJKIEJ-UHFFFAOYSA-N
ID: 32877
SMILES:C(C=C(C)C)CC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 32878
SMILES:Oc1cc(CCCC)c(O)c2c1OC(C)(C)C1(O)C(CC(C)=CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.251
InChIKey:ROIKPQTYFAKFMV-UHFFFAOYSA-N
ID: 32879
SMILES:C1=CC2C(C(C)(C)Oc3cc(C)c(O)cc32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 230.307
CB1 binding score: -15.043
InChIKey:GCGZALDDKOFWMG-UHFFFAOYSA-N
ID: 32880
SMILES:c1c(C(CC(NCC#C)=O)CCCC)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.571
CB1 binding score: -16.08
InChIKey:CAMIYLBQEMSNMS-UHFFFAOYSA-N
ID: 32881
SMILES:C(C)(CCC=C(C)C)=CCc1c(OC)cc(CCCCC)c(C(O)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -19.037
InChIKey:VAFRUJRAAHLCFZ-UHFFFAOYSA-N
ID: 32882
SMILES:C1(C)(O)CCC=C(c2c(OC(C)=O)cc(CCCCC)cc2O)C1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -12.967
InChIKey:SESKVWRGMXLDJF-UHFFFAOYSA-N
ID: 32883
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(O)(C)C3CC3C(=C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -11.242
InChIKey:HCDXSOSMAACLGC-UHFFFAOYSA-N
ID: 32884
SMILES:CC1(C)C2CCC(C)=CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 32885
SMILES:C(CC1c2c(O)cc(CCCCC)cc2OC(C)(C)C1)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -15.056
InChIKey:RJNHFFQRLYXWIG-UHFFFAOYSA-N
ID: 32886
SMILES:C(C)CCCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 294.391
CB1 binding score: -15.313
InChIKey:LTMXPENGAYZLFR-UHFFFAOYSA-N