ID: 29527
SMILES:C1=CCCC(C)=C2c3c(cc(CCC)c(C(OC)=O)c3O)OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.871
InChIKey:LGKQNDVUUPSXIX-UHFFFAOYSA-N
ID: 29528
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 29529
SMILES:c12cc(CCCCC)ccc1OC(C)(C)C1C(C)(CCC2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.605
InChIKey:ZMJCZLALMLWQLY-UHFFFAOYSA-N
ID: 29530
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 29531
SMILES:C(=C(C(=O)OCC(C)C1(C)CCC(C)=CC1c1c(O)cc(CCCCCO)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.114
InChIKey:JEXSEABPZFHAOM-UHFFFAOYSA-N
ID: 29532
SMILES:C(CCCCc1cc(=O)c2c(cc1)OC(C)(C)C1CCC(C(O)=O)=CC21)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.486
InChIKey:HNRLDGACZLAVHO-UHFFFAOYSA-N
ID: 29533
SMILES:OC1(C)CC2C(C)(C)C2C(Oc2c(CCCCC)cc(O)c(CC=C(C)C)c2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.821
InChIKey:ZCKRAJKJORFBAH-UHFFFAOYSA-N
ID: 29534
SMILES:C1CC(C(C)C)C2c3c(c(C(OC)=O)c(CCCCC)cc3O)OC(C)(C)OC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -9.451
InChIKey:AFAKOXKBFJWPAN-UHFFFAOYSA-N
ID: 29535
SMILES:CC(C)=CCc1c(C(C(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -12.489
InChIKey:SLQIIMIEJVUCRB-UHFFFAOYSA-N
ID: 29536
SMILES:c1c(C2CC(C)=CC(c3c(OC)ccc(CC[N+](C)(C)O)c3)C2C(C)=C)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.59
CB1 binding score: -14.846
InChIKey:SDNVAIVHASPVJO-UHFFFAOYSA-N
ID: 29537
SMILES:CC1=CCC2c3c(cc(CCCCC)cc3O)OC(CO)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.561
InChIKey:PWXVNYIORXRWNL-UHFFFAOYSA-N
ID: 29538
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C(OC(C)=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.897
InChIKey:SSFOSMXKZCFHAJ-UHFFFAOYSA-N
ID: 29539
SMILES:C(=O)C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.335
InChIKey:GURCANHZGGCWNT-UHFFFAOYSA-N
ID: 29540
SMILES:O(c1ccc2c(c1O)C1C(C(C)(C)O2)CCC(COC(=O)C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -14.591
InChIKey:HCYWKJGKOXPBLE-UHFFFAOYSA-N
ID: 29541
SMILES:O=C(Oc1c2c(cc(CCCC)c1)OC(C)(C)C1CCC(C)=CC21)C=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.959
InChIKey:OWFMJUONMSUACS-UHFFFAOYSA-N
ID: 29542
SMILES:C(CCCCCCC)CCCC(C)Cc1cc2c(c(O)c1)C1CC(C)(CCC2C(C)(C)O1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.727
CB1 binding score: -15.048
InChIKey:NEJKBZIYEKRDNS-UHFFFAOYSA-N
ID: 29543
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 29544
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(=C)C1CC=C(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.449
InChIKey:SGZCREHPLUEXFH-UHFFFAOYSA-N
ID: 29545
SMILES:C(C(=CCc1c(O)cc(CCCCC)c(OC)c1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.615
InChIKey:RBAMEMWAPDBZPD-UHFFFAOYSA-N
ID: 29546
SMILES:c1(C)c(C(C)CCCC)cc(O)c2c1OC(C)(C)C1CCC(C)(OC)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -10.678
InChIKey:ASJJGHIRSIEOKG-UHFFFAOYSA-N
ID: 29547
SMILES:C1=C(C)CC(=O)C2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.469
CB1 binding score: -13.252
InChIKey:UQWZUXGDSOCOLV-UHFFFAOYSA-N