ID: 34840
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 34841
SMILES:C12(Oc3ccc(CCCCC)cc31)C1(C)CC(O)C(C(O)(C)C)C(O)C1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -12.712
InChIKey:PPGAREHASKMKFU-UHFFFAOYSA-N
ID: 34842
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C(=C)C)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.106
InChIKey:YYLUBELGCDKWSY-UHFFFAOYSA-N
ID: 34843
SMILES:c1(O)cc(CCCC)cc2c1-c1c(O)c(CCC=C(C)C)ccc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -13.274
InChIKey:SKJULLNRAPMDNL-UHFFFAOYSA-N
ID: 34844
SMILES:C=C(C1C2(C(C)=CC1)Oc1c(c(O)cc(CCCCC)c1)C2)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.135
InChIKey:SUXIWMWOMJUYQL-UHFFFAOYSA-N
ID: 34845
SMILES:C(C1=CC2c3c(O)cc(CCCCC)cc3OC(C)(CCC1C(C)(O)C)C=C2)(CC1C(C)(C)O1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -15.929
InChIKey:NFHLAFIBPGEJIB-UHFFFAOYSA-N
ID: 34846
SMILES:C(=CCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.19
InChIKey:TYISBZUJZXOOLZ-UHFFFAOYSA-N
ID: 34847
SMILES:C(c1ccccc1)CC(c1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -15.112
InChIKey:MGQWQWPKHMPBFI-UHFFFAOYSA-N
ID: 34848
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 34849
SMILES:C(Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.691
InChIKey:JUCOHRGEXRGBDB-UHFFFAOYSA-N
ID: 34850
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 34851
SMILES:C(CCC)Cc1ccc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N
ID: 34852
SMILES:C1CC2C(C)(C)Oc3c(cccc3)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 34853
SMILES:C(C)(C)C(O)Cc1c2c(c(O)c(C(=O)CCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.145
InChIKey:WYHPOBHKAZKKFO-UHFFFAOYSA-N
ID: 34854
SMILES:C(CCCCc1c(C)cc2c(c1O)C1C(C(C)C)CCC(C)(O2)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -17.971
InChIKey:KHTZRECECNUCOJ-UHFFFAOYSA-N
ID: 34855
SMILES:CCCCCc1cc2c(c(O)c1)C1(O)C2C(C(C)(C)O)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.163
InChIKey:HHAQCJNTPOKHDH-UHFFFAOYSA-N
ID: 34856
SMILES:C1C(O)C(C)=CC2C1C(C)(C)Oc1cc(C)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.342
InChIKey:PYHMVTAXZLXDSA-UHFFFAOYSA-N
ID: 34857
SMILES:C1Oc2cc(CCCC)cc(O)c2C2CC(C)=CC(=O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: Not available
InChIKey:QWHIFDKWHPUUCG-UHFFFAOYSA-N
ID: 34858
SMILES:Oc1cc(CCCC)c(Cl)c(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 336.903
CB1 binding score: -16.277
InChIKey:MNFPWAWOYZUWIQ-UHFFFAOYSA-N
ID: 34859
SMILES:CC1(C)CCCC(C)(c2c(O)cc(CCCCC)cc2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -15.963
InChIKey:MRIMQGDLEMOVQW-UHFFFAOYSA-N
ID: 34860
SMILES:CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N